2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide

C23H24N4O — CID 55705535

IUPAC2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide
SMILESO=C(NC1CCN(c2ncccn2)CC1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H24N4O/c28-22(21(18-8-3-1-4-9-18)19-10-5-2-6-11-19)26-20-12-16-27(17-13-20)23-24-14-7-15-25-23/h1-11,14-15,20-21H,12-13,16-17H2,(H,26,28)
InChIKeyPOHDBOAJXMLSBP-UHFFFAOYSA-N
MW372.47 g/mol
LogP3.39
Rot. Bonds5

About 2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide

2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide (PubChem CID 55705535) has the molecular formula C23H24N4O and a molecular weight of 372.47 g/mol. Its IUPAC name is 2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide.

Molecular Properties

Compound Name2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide
PubChem CID55705535
Molecular FormulaC23H24N4O
Molecular Weight372.47 g/mol
Exact Mass372.20
IUPAC Name2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide
SMILESO=C(NC1CCN(c2ncccn2)CC1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H24N4O/c28-22(21(18-8-3-1-4-9-18)19-10-5-2-6-11-19)26-20-12-16-27(17-13-20)23-24-14-7-15-25-23/h1-11,14-15,20-21H,12-13,16-17H2,(H,26,28)
InChIKeyPOHDBOAJXMLSBP-UHFFFAOYSA-N
XLogP3.39
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(3S)-3-phenylbutyl]-3-(1-pyrimidin-2-ylpiperidin-4-yl)urea
CID 52511655
2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
CID 62639471
2-(4-phenylphenyl)-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide
CID 55721980
(2R)-2-pyridin-3-yl-N-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyrrolidin-1-ylacetamide
CID 125167230
3-chloro-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
CID 62728860
2-amino-N-(1-pyrimidin-2-ylpiperidin-4-yl)butanediamide
CID 60846790
2,2-diphenyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
CID 3636025
6-[(1R)-1-phenylethoxy]-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridine-3-carboxamide
CID 51956656
2,2-diphenyl-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]acetamide
CID 108549584
2-[2-oxo-2-[(1-pyrimidin-2-ylpiperidin-4-yl)amino]ethyl]sulfanylacetic acid
CID 104569240
(2S)-2-amino-N-(1-pyrimidin-2-ylpiperidin-4-yl)hexanamide
CID 103831283
(2S)-2-amino-3-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)pentanamide
CID 61172472

Frequently Asked Questions

What is the IUPAC name of 2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide?
The IUPAC name of 2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide (CID 55705535) is 2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide.
What is the SMILES notation for 2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide?
The canonical SMILES for 2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide is O=C(NC1CCN(c2ncccn2)CC1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide?
The InChIKey is POHDBOAJXMLSBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O/c28-22(21(18-8-3-1-4-9-18)19-10-5-2-6-11-19)26-20-12-16-27(17-13-20)23-24-14-7-15-25-23/h1-11,14-15,20-21H,12-13,16-17H2,(H,26,28).
What are the key properties of 2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide?
2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide has a molecular weight of 372.47 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide is sourced from PubChem (CID 55705535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).